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Substance Name: Benzoic acid, p-aminothio-, S-4-(diethylamino)butyl ester, phosphate
ID: DG32000000
InChIKey: QNJCUSSDGLVUCB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-N2-O-S.H3-O4-P

Molecular Weight

  • 378.4273
 
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Names and Synonyms

Synonyms

  • 1-Butanethiol, 4-diethylamino-, p-aminobenzoate, phosphate
  • p-Aminothiobenzoic acid, S-4-(diethylamino)butyl ester phosphate

Systematic Name

  • Benzoic acid, p-aminothio-, S-4-(diethylamino)butyl ester, phosphate

Registry Numbers

ID Number

  • NIOSH/DG3200000

System Generated Number

  • DG32000000

Molecular Formulas

Molecular Formula

  • C15-H24-N2-O-S.H3-O4-P

Molecular Formula Fragments

  • C15-H24-N2-O-S
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C15H24N2OS.H3O4P/c1-3-17(4-2)11-5-6-12-19-15(18)13-7-9-14(16)10-8-13;1-5(2,3)4/h7-10H,3-6,11-12,16H2,1-2H3;(H3,1,2,3,4)

InChIKey

QNJCUSSDGLVUCB-UHFFFAOYSA-N

Smiles

CCN(CC)CCCCSC(=O)c1ccc(N)cc1.OP(=O)(O)O